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Propanoic acid, 3-[(1-methylethyl)thio]-
SpectraBase Compound ID 4IcNJoV0cxL
InChI InChI=1S/C6H12O2S/c1-5(2)9-4-3-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey BSMZRZIXCAUUCT-UHFFFAOYSA-N
Mol Weight 148.22 g/mol
Molecular Formula C6H12O2S
Exact Mass 148.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ropPCXGE4
Name Propanoic acid, 3-[(1-methylethyl)thio]-
Alternate Name(s) 3-(Isopropylsulfanyl)propanoic acid 3-(isopropylthio)propionic acid 3-(propan-2-ylthio)propanoic acid 3-Propan-2-ylsulfanylpropanoic acid Propionic acid, 3-(isopropylthio)-
CAS Registry Number 24383-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2S
InChI InChI=1S/C6H12O2S/c1-5(2)9-4-3-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey BSMZRZIXCAUUCT-UHFFFAOYSA-N
Molecular Weight 148.220 g/mol
SMILES OC(CCSC(C)C)=O
SPLASH splash10-002v-9200000000-c18a1cf155eaa79ac9ce
Source of Spectrum B-22-1212-3
Wiley ID 9490